Methyl 2-Boc-4-isoindolinecarboxylate - CAS 1710854-30-0
Catalog: |
BB012712 |
Product Name: |
Methyl 2-Boc-4-isoindolinecarboxylate |
CAS: |
1710854-30-0 |
Synonyms: |
1,3-dihydroisoindole-2,4-dicarboxylic acid O2-tert-butyl ester O4-methyl ester; 2-O-tert-butyl 4-O-methyl 1,3-dihydroisoindole-2,4-dicarboxylate |
IUPAC Name: | 2-O-tert-butyl 4-O-methyl 1,3-dihydroisoindole-2,4-dicarboxylate |
Description: | Methyl 2-Boc-4-isoindolinecarboxylate (CAS# 1710854-30-0 ) is a useful research chemical. |
Molecular Weight: | 277.32 |
Molecular Formula: | C15H19NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC2=CC=CC(=C2C1)C(=O)OC |
InChI: | InChI=1S/C15H19NO4/c1-15(2,3)20-14(18)16-8-10-6-5-7-11(12(10)9-16)13(17)19-4/h5-7H,8-9H2,1-4H3 |
InChI Key: | LQLUNYBFJANXPA-UHFFFAOYSA-N |
LogP: | 2.66180 |
Publication Number | Title | Priority Date |
WO-2021055641-A1 | Fibroblast activation protein (fap)-targeted imaging and therapy of cancers and other fibrotic and inflammatory diseases | 20190917 |
WO-2018205948-A1 | Compounds | 20170511 |
EP-3429994-A1 | 2-cyanoisoindoline derivatives for treating cancer | 20160318 |
US-10683269-B2 | 2-cyanoisoindoline derivatives for treating cancer | 20160318 |
US-2019010122-A1 | 2-cyanoisoindoline derivatives for treating cancer | 20160318 |
Complexity: | 388 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.13140809 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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